Y020-8497 Screening compound: N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}methanesulfonamide

Y020-8497 Screening compound: N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}methanesulfonamide
Y020-8497 Screening compound: N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}methanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8497
N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}methanesulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y020-8497

Molecular Formula

C14H22N4O4S (C14 H22 N4 O4 S)

Compound Name

N-{5-[2-(3,4-dimethoxyphenyl)ethyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}methanesulfonamide

IUPAC name

N-{5-[2-(34-dimethoxyphenyl)ethyl]-1456-tetrahydro-135-triazin-2-yl}methanesulfonamide

SMILES

COc(ccc(CCN1CN=C(NS(C)(=O)=O)NC1)c1)c1OC

InChI

InChI=1S/C14H22N4O4S/c1-21-12-5-4-11(8-13(12)22-2)6-7-18-9-15-14(16-10-18)17-23(3,19)20/h4-5,8H,6-7,9-10H2,1-3H3,(H2,15,16,17)

InChI Key

VQVYXNXHEAKXEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15195719

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.436

Distribution Coefficient, logD

0.436

Water Solubility, LogSw

-2.31

Polar Surface Area

81.239

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

6.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y020-8497 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with Y020-8497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8497?
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What is the minimum amount of Y020-8497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8497
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y020-8497 available by request